CFam Chemical Families Database
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You are searching for "CFAMM00334281" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00334281
Family CFFBM2442 Aurora kinase A and Aurora kinase B inhibitor AGN-PC-09M46L family
Superfamily CFSBM1150 Aurora kinase B and Aurora kinase A Binder Superfamily
Class CFCBM444 Class 3494
External ID CHEMBL2023299 External Source CHEMBL
PubChem CID 44177838 Functional Category Bioactive
Molecule Name 2-[4-[6-methyl-8-[[3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-yl]amino]imidazo[1,2-a]pyrazin-3-yl]pyrazol-1-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
IUPAC Name 2-[4-[6-methyl-8-[[3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-yl]amino]imidazo[1,2-a]pyrazin-3-yl]pyrazol-1-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
Synonyms SureCN13155064;AGN-PC-0720ZC;2-[4-[6-methyl-8-[[3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-yl]amino]imidazo[1,2-a]pyrazin-3-yl]pyrazol-1-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
InChi InChI=1S/C30H32F3N9OS/c1-19-4-3-9-40(14-19)17-24-10-27(44-39-24)38-28-29-35-13-25(42(29)15-20(2)37-28)22-12-36-41(16-22)18-26(43)34-11-21-5-7-23(8-6-21)30(31,32)33/h5-8,10,12-13,15-16,19H,3-4,9,11,14,17-18H2,1-2H3,(H,34,43)(H,37,38)
InChiKey KWNOUBVBEBGONG-UHFFFAOYSA-N
Formula C30H32F3N9OS Molecular Weight 623.69
Cross Link CHEMBL2023299
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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